methyl 1-(phenylmethyl)pyrrolidin-1-ium-1-carboxylate

Systemtic Name: methyl 1-(phenylmethyl)pyrrolidin-1-ium-1-carboxylate Openeye Name: methyl 1-benzylpyrrolidin-1-ium-1-carboxylate CAS Name: 1-(phenylmethyl)-1-pyrrolidin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 1-benzylpyrrolidin-1-ium-1-carboxylate Traditional Name: 1-benzylpyrrolidin-1-ium-1-carboxylic acid methyl ester Formula: C13H18NO2+ MolecularWeight: 220.28752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)[N+]1(CCCC1)CC2=CC=CC=C2

Isomeric SMILES

COC(=O)[N+]1(CCCC1)CC2=CC=CC=C2

InChI

InChI=1S/C13H18NO2/c1-16-13(15)14(9-5-6-10-14)11-12-7-3-2-4-8-12/h2-4,7-8H,5-6,9-11H2,1H3/q+1